Vitas-M small molecule compound
(3S,3aR,8aR,9aR)-3-((4-(3,4-dimethylphenyl)piperazin-1-yl)methyl)-8a-methyldecahydro-2H-spiro[naphtho[2,3-b]furan-5,2'-oxiran]-2-one
Catalog ID
STL532007
SMILES O=C1O[C@H]2[C@@H](C1CN1CCN(CC1)c1ccc(c(c1)C)C)CC1[C@](C2)(C)CCCC21OC2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C27H38N2O3 MW 438.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H38N2O3/c1-18-5-6-20(13-19(18)2)29-11-9-28(10-12-29)16-22-21-14-24-26(3,15-23(21)32-25(22)30)7-4-8-27(24)17-31-27/h5-6,13,21-24H,4,7-12,14-17H2,1-3H3/t21-,22?,23-,24?,26-,27?/m1/s1InChIKey
SIYYOCXGINPJHS-SQOGIVKGSA-NSynonyms
1212478-58-4(3~(a)~(R)8~(a)~(R)9~(a)~(R))3((4(34dimethylphenyl)piperazin1yl)methyl)8~(a)methylspiro(3~(a)44~(a)67899~(a)octahydro3~(H)benzo(f)(1)benzofuran52oxirane)2one
(3S3aR8aR9aR)3((4(34dimethylphenyl)piperazin1yl)methyl)8amethyldecahydro2Hspiro(naphtho(23b)furan52oxiran)2one
1212478584
16403737
InChI=1SC27H38N2O3c1185620(1319(18)2)2911928(101229)162221142426(31523(21)3225(22)30)74827(24)173127h56132124H47121417H213H3t2122?2324?2627?m1s1
O=C1O(C@H)2(C@@H)(C1CN1CCN(CC1)c1ccc(c(c1)C)C)CC1(C@)(C2)(C)CCCC21OC2
ZINC000059415286
ZINC000082051412
Check stock
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